N-[1-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: N-[1-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: N-[1-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylcarbamoyl]-3-methylsulfanyl-propyl]benzamide CAS Name: N-[1-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: N-[1-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: N-[1-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylcarbamoyl]-3-(methylthio)propyl]benzamide Formula: C22H26N2O4S MolecularWeight: 414.51784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCCO2)NC(=O)C(CCSC)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCCO2)NC(=O)C(CCSC)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H26N2O4S/c1-15(17-8-9-19-20(14-17)28-12-11-27-19)23-22(26)18(10-13-29-2)24-21(25)16-6-4-3-5-7-16/h3-9,14-15,18H,10-13H2,1-2H3,(H,23,26)(H,24,25)